N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide

C12H14FNO — CID 60630491

IUPACN-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide
SMILESCC(NC(=O)C1CC1)c1cccc(F)c1
InChIInChI=1S/C12H14FNO/c1-8(14-12(15)9-5-6-9)10-3-2-4-11(13)7-10/h2-4,7-9H,5-6H2,1H3,(H,14,15)
InChIKeyLLZHDQWURICIHY-UHFFFAOYSA-N
MW207.25 g/mol
LogP2.41
Rot. Bonds3

About N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide

N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide (PubChem CID 60630491) has the molecular formula C12H14FNO and a molecular weight of 207.25 g/mol. Its IUPAC name is N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide
PubChem CID60630491
Molecular FormulaC12H14FNO
Molecular Weight207.25 g/mol
Exact Mass207.11
IUPAC NameN-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide
SMILESCC(NC(=O)C1CC1)c1cccc(F)c1
InChIInChI=1S/C12H14FNO/c1-8(14-12(15)9-5-6-9)10-3-2-4-11(13)7-10/h2-4,7-9H,5-6H2,1H3,(H,14,15)
InChIKeyLLZHDQWURICIHY-UHFFFAOYSA-N
XLogP2.41
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.25
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(aminomethyl)-N-[1-(3-fluorophenyl)ethyl]cyclohexane-1-carboxamide
CID 79526822
3-amino-N-[(1S)-1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide
CID 81365977
1-acetyl-N-[1-(3-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 42907119
3-amino-N-[1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide
CID 66008581
N-[1-(3-fluorophenyl)ethyl]pyrrolidine-3-carboxamide
CID 63005470
N-[(1S)-1-(3-fluorophenyl)ethyl]-2-methylpiperidine-4-carboxamide
CID 106740405
1-N-cyclopropyl-4-N-[1-(3-fluorophenyl)ethyl]piperidine-1,4-dicarboxamide
CID 51083881
1-N,4-N-bis[(1S)-1-phenylethyl]cyclohexane-1,4-dicarboxamide
CID 40636599
2-amino-N-[(1S)-1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide
CID 81366049
2-amino-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclohexane-1-carboxamide
CID 81365382
N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide
CID 81366934
2-amino-N-[(1S)-1-(3-fluorophenyl)ethyl]cycloheptane-1-carboxamide
CID 81366921

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide?
The IUPAC name of N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide (CID 60630491) is N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide?
The canonical SMILES for N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide is CC(NC(=O)C1CC1)c1cccc(F)c1.
What is the InChIKey of N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide?
The InChIKey is LLZHDQWURICIHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO/c1-8(14-12(15)9-5-6-9)10-3-2-4-11(13)7-10/h2-4,7-9H,5-6H2,1H3,(H,14,15).
What are the key properties of N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide?
N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide has a molecular weight of 207.25 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide is sourced from PubChem (CID 60630491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).